| Phytochemical Name : tert-Butyl 4-bromo-1H-indazole-1-carboxylate |
| PCNDIDT0027 |
| Pubchem CID : 37819147 |
| Molecular formula: C12H13BrN2O2 |
| Canonical SMILES : CC(C)(C)OC(=O)N1C2=C(C=N1)C(=CC=C2)Br |
Synonymes : 1-Boc-4-bromo-1H-indazole|926922-37-4|tert-Butyl 4-bromo-1H-indazole-1-carboxylate|tert-butyl 4-bromoindazole-1-carboxylate|MFCD11110271|1H-Indazole-1-carboxylic acid, 4-bromo-, 1,1-dimethylethyl ester|4-Bromo-1H-indazole, N1-BOC protected|4-Bromo-indazole-1-carboxylic acid tert-butyl ester|SCHEMBL17632197|DTXSID20653355|BCP23484|CS-D0832|AKOS005258585|PS-7149|AC-23610|SY014186|AM20050486|FT-0685628|EN300-7361352|4-Bromoindazole-1-carboxylic acid tert-butyl ester|A860002|J-524687 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.030 |
| Log Po/w (XLOGP3) : 3.530 |
| Log Po/w (WLOGP) : 3.580 |
| Log Po/w (MLOGP) : 2.990 |
| Log Po/w (SILICOS-IT) : 2.200 |
| Consensus Log Po/w : 3.070 |